![1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one structure](/static/products/229/22975-38-8.png)
1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one
TL;DR: 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one (CAS 22975-38-8) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8,8-trimethylbicyclo[3.2.1]oct-3-en-2-one
Also Known As: 5,8,8-trimethylbicyclo[3.2.1]oct-2-en-4-one, 1,8,8-TRIMETHYLBICYCLO[3.2.1]OCT-3-EN-2-ONE, 1,8,8-trimethylbicyclo[3.2.1]oct-3-en-2-one (en)
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 2.5678 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 262.17767 |
Chemical Identifiers
| CAS Number | 22975-38-8 |
|---|---|
| SMILES | CC1(C2CCC1(C(=O)C=C2)C)C |
Product Overview
1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one (CAS 22975-38-8), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: 1,8,8-trimethylbicyclo[3.2.1]oct-3-en-2-one.
Chemical Property Profile of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one
Property Insights of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one
The XLogP value of 2.5678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one. With a topological polar surface area (TPSA) of 17.07 Ų, 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one?
The CAS number of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one is 22975-38-8.
What is the molecular formula of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one?
The molecular formula of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one is C11H16O.
What is the molecular weight of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one?
The molecular weight of 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one is 164.12 g/mol.
Where can I buy 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one?
You can request a quote for 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,8,8-Trimethylbicyclo[3.2.1]oct-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.